State-to-State Reactive Scattering via RealL2Wave Packet Propagation for Reduced Dimensionality AB + CD Reactions†

Sergei Skokov; Joel M. Bowman

doi:10.1021/jp0022151

State-to-State Reactive Scattering via RealL2Wave Packet Propagation for Reduced Dimensionality AB + CD Reactions†

The Journal of Physical Chemistry A ◽

10.1021/jp0022151 ◽

2001 ◽

Vol 105 (12) ◽

pp. 2502-2508 ◽

Cited By ~ 2

Author(s):

Sergei Skokov ◽

Joel M. Bowman

Keyword(s):

Reactive Scattering ◽

Reduced Dimensionality

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Reduced dimensionality diatom–diatom reactive scattering: Application to a model H2+A2→H+HA2reaction

The Journal of Chemical Physics ◽

10.1063/1.458164 ◽

1990 ◽

Vol 92 (2) ◽

pp. 1021-1029 ◽

Cited By ~ 19

Author(s):

Qiyan Sun ◽

Joel M. Bowman

Keyword(s):

Reactive Scattering ◽

Reduced Dimensionality

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Reduced dimensionality theory of quantum reactive scattering

The Journal of Physical Chemistry ◽

10.1021/j100166a014 ◽

1991 ◽

Vol 95 (13) ◽

pp. 4960-4968 ◽

Cited By ~ 330

Author(s):

Joel M. Bowman

Keyword(s):

Reactive Scattering ◽

Reduced Dimensionality ◽

Dimensionality Theory ◽

Quantum Reactive Scattering

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Reduced-dimensionality quantum reactive scattering calculations of the C(3P)+C2H2 reaction on a new potential energy surface

Chemical Physics ◽

10.1016/j.chemphys.2004.11.026 ◽

2005 ◽

Vol 312 (1-3) ◽

pp. 61-67 ◽

Cited By ~ 8

Author(s):

Toshiyuki Takayanagi

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Energy Surface ◽

Reactive Scattering ◽

Reduced Dimensionality ◽

Quantum Reactive Scattering

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Reduced Dimensionality Theories of Quantum Reactive Scattering: Applications to Mu+H2, H+H2, O(3P)+H2, D2 and HD

The Theory of Chemical Reaction Dynamics ◽

10.1007/978-94-009-4618-7_3 ◽

1986 ◽

pp. 47-76 ◽

Cited By ~ 19

Author(s):

Joel M. Bowman ◽

Albert F. Wagner

Keyword(s):

Reactive Scattering ◽

Reduced Dimensionality ◽

Quantum Reactive Scattering

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Reduced dimensionality calculations of quantum reactive scattering for the H+CH4→H2+CH3 reaction

The Journal of Chemical Physics ◽

10.1063/1.470920 ◽

1996 ◽

Vol 104 (6) ◽

pp. 2237-2242 ◽

Cited By ~ 74

Author(s):

Toshiyuki Takayanagi

Keyword(s):

Reactive Scattering ◽

Reduced Dimensionality ◽

Quantum Reactive Scattering

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A reduced dimensionality quantum reactive scattering study of the insertion reaction O(1D)+H2→OH+H

The Journal of Chemical Physics ◽

10.1063/1.457502 ◽

1989 ◽

Vol 91 (1) ◽

pp. 142-149 ◽

Cited By ~ 38

Author(s):

Jay K. Badenhoop ◽

Hiroyasu Koizumi ◽

George C. Schatz

Keyword(s):

Insertion Reaction ◽

Reactive Scattering ◽

Reduced Dimensionality ◽

Scattering Study ◽

Quantum Reactive Scattering

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Parallelization strategies for a reduced dimensionality calculation of quantum reactive scattering cross sections on a hypercube machine

High-Performance Computing and Networking - Lecture Notes in Computer Science ◽

10.1007/bfb0046681 ◽

1995 ◽

pp. 554-561 ◽

Cited By ~ 11

Author(s):

R. Baraglia ◽

D. Laforenza ◽

A. Laganà

Keyword(s):

Cross Sections ◽

Reactive Scattering ◽

Reduced Dimensionality ◽

Scattering Cross ◽

Scattering Cross Sections ◽

Quantum Reactive Scattering

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Reduced dimensionality quantum reactive scattering calculations on the ab initio potential energy surface for the O()+N2O→NO+NO reaction

Chemical Physics ◽

10.1016/s0301-0104(01)00357-3 ◽

2001 ◽

Vol 269 (1-3) ◽

pp. 37-47 ◽

Cited By ~ 10

Author(s):

Toshiyuki Takayanagi ◽

Akira Wada

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Ab Initio ◽

Energy Surface ◽

Reactive Scattering ◽

Reduced Dimensionality ◽

Quantum Reactive Scattering

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Reduced dimensionality quantum reactive scattering: H2+CN→H+HCN

The Journal of Chemical Physics ◽

10.1063/1.458555 ◽

1990 ◽

Vol 92 (9) ◽

pp. 5201-5210 ◽

Cited By ~ 95

Author(s):

Qiyan Sun ◽

Joel M. Bowman

Keyword(s):

Reactive Scattering ◽

Reduced Dimensionality ◽

Quantum Reactive Scattering

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Overview of reduced dimensionality quantum approaches to reactive scattering

Theoretical Chemistry Accounts ◽

10.1007/s00214-002-0359-5 ◽

2002 ◽

Vol 108 (3) ◽

pp. 125-133 ◽

Cited By ~ 36

Author(s):

Joel M. Bowman

Keyword(s):

Reactive Scattering ◽

Reduced Dimensionality

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